(2-Chlorobenzyl)(triphenyl)phosphorane

HCID 494175

Notes Reactions

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Basic information

CAS: 18583-55-6
Standard SMILES: Clc1ccccc1C[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChIKey: WHFQQMOBBNYMPG-UHFFFAOYSA-N
Molecular formula: C25H21ClP+
Average molar mass: 387.9 g/mol

Names & identifiers

Preferred name: (2-Chlorobenzyl)(triphenyl)phosphorane
IUPAC: (2-chlorophenyl)methyl-triphenylphosphanium

Names & synonyms

(2-Chlorobenzyl)(triphenyl)phosphoraneNSC 210534NSC210534CHEMBL3306735SCHEMBL14520594SCHEMBL31412768(2-chlorophenyl)methyl-triphenyl-phosphonium

Database identifiers

CAS: 18583-55-6
PubChem CID: 494175
ChEMBL: CHEMBL3306735
Nikkaji: J1.695.752F

Properties

Computed structural propertiesFilling in

XLogP: 6.7
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 5
Heavy atoms: 27
Formal charge: 1
Complexity: 386

Related reactions

3 records

New reaction record

HRID 1152553 reaction equation

HRID 1152553As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1227344 reaction equation

HRID 1227344As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 2327110 reaction equation

HRID 2327110As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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